#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 2qp0 n ARG 2 N 0.00 -1.22 -2.26 0.54 3.00 -1.26 -5.02 116.66 110.44 2qp0 n ARG 2 Ca 0.00 0.80 -0.28 0.00 -0.01 0.00 0.00 57.85 58.36 2qp0 n ARG 2 Cb 0.00 -4.31 0.02 0.00 0.00 0.00 0.00 32.46 28.17 2qp0 n ARG 2 CO 0.00 0.00 0.00 -1.12 0.00 0.00 0.00 177.63 176.51 2qp0 s SER 3 N -3.01 5.94 0.00 0.55 0.01 -1.26 -4.94 113.70 110.99 2qp0 s SER 3 Ca 0.18 1.02 0.00 0.00 1.31 0.00 0.00 55.95 58.46 2qp0 s SER 3 Cb -0.02 -2.10 0.00 0.00 0.21 0.00 0.00 66.02 64.10 2qp0 s SER 3 CO 0.48 -0.90 0.07 -0.11 0.41 0.00 0.00 173.24 173.19 2qp0 n LEU 4 N -2.59 0.00 0.00 2.44 0.00 -1.26 -5.09 117.00 110.50 2qp0 n LEU 4 Ca 0.04 -0.17 0.00 0.00 0.00 0.00 0.00 56.01 55.88 2qp0 n LEU 4 Cb 0.56 0.00 0.00 0.00 0.00 0.00 0.00 43.42 43.98 2qp0 n LEU 4 CO 0.55 0.53 0.00 0.29 0.00 0.00 0.00 177.39 178.76 2qp0 n LYS 5 N 0.00 0.00 -3.93 1.96 4.01 -1.26 -3.63 118.16 115.30 2qp0 n LYS 5 Ca 0.00 0.00 -0.29 0.00 -0.51 0.00 0.00 58.31 57.51 2qp0 n LYS 5 Cb 0.09 0.00 -0.16 0.00 -0.51 0.00 0.00 35.03 34.45 2qp0 n LYS 5 CO 0.00 0.00 0.00 0.15 -1.11 0.00 0.00 177.40 176.44 2qp0 s LYS 6 N 0.00 1.70 0.00 1.97 -0.14 -1.26 -4.94 119.74 117.06 2qp0 s LYS 6 Ca 0.00 -0.57 0.00 0.00 -1.36 0.00 0.00 55.97 54.04 2qp0 s LYS 6 Cb 0.00 -2.07 0.00 0.00 -1.68 0.00 0.00 37.83 34.08 2qp0 s LYS 6 CO 0.00 -0.39 0.00 0.41 -0.76 0.00 0.00 175.35 174.61 2qp0 n GLY 7 N 4.82 0.20 3.56 -3.33 0.00 -1.24 -5.06 105.19 104.15 2qp0 n GLY 7 Ca -0.13 -0.54 -0.41 0.00 0.00 0.00 0.00 46.02 44.94 2qp0 n GLY 7 CO 0.00 0.00 0.00 -1.05 0.00 0.00 0.00 173.32 172.27 2qp0 n PRO 8 N 0.00 1.43 -3.07 1.61 -0.02 -1.26 -4.92 135.00 128.77 2qp0 n PRO 8 Ca 0.00 0.28 -0.40 0.00 -2.02 0.00 0.00 63.50 61.37 2qp0 n PRO 8 Cb 0.00 -3.16 -0.05 0.00 -0.02 0.00 0.00 33.50 30.27 2qp0 n PRO 8 CO 0.00 0.00 0.00 0.12 1.98 0.00 0.00 175.50 177.60 2qp0 s PHE 9 N 9.71 3.67 -0.04 6.00 2.19 -1.26 -4.98 117.98 133.27 2qp0 s PHE 9 Ca 1.02 1.32 0.04 0.00 0.33 0.00 0.00 56.93 59.65 2qp0 s PHE 9 Cb -0.38 -2.76 -0.00 0.00 -1.31 0.00 0.00 43.02 38.57 2qp0 s PHE 9 CO 0.34 0.23 -0.17 0.42 1.83 0.00 0.00 175.22 177.88 2qp0 s ILE 10 N 0.18 1.39 -0.27 3.12 1.09 -1.26 -3.39 121.20 122.06 2qp0 s ILE 10 Ca 0.36 -0.70 -0.28 0.00 -1.10 0.00 0.00 60.65 58.93 2qp0 s ILE 10 Cb -0.19 -1.19 -0.04 0.00 -1.06 0.00 0.00 42.46 39.98 2qp0 s ILE 10 CO 0.20 0.40 2.04 -1.81 -0.10 0.00 0.00 174.94 175.67 2qp0 s ASP 11 N -0.02 5.62 0.21 3.58 1.11 -1.26 -4.87 116.67 121.05 2qp0 s ASP 11 Ca -0.02 1.61 -0.20 0.00 0.18 0.00 0.00 52.55 54.12 2qp0 s ASP 11 Cb -0.11 -2.52 0.17 0.00 1.07 0.00 0.00 42.92 41.54 2qp0 s ASP 11 CO 0.02 -1.87 1.55 0.25 1.18 0.00 0.00 175.17 176.30 2qp0 h LEU 12 N 14.56 -1.57 -0.92 1.23 6.46 -1.98 0.13 115.31 133.22 2qp0 h LEU 12 Ca -0.37 0.31 0.26 0.00 -0.12 0.00 0.00 57.88 57.96 2qp0 h LEU 12 Cb 1.21 0.79 -0.17 0.00 -0.73 0.00 0.00 40.66 41.76 2qp0 h LEU 12 CO 1.00 -0.28 0.04 1.41 -0.62 0.00 0.00 178.44 179.99 2qp0 n HIS 13 N -5.43 0.61 -0.02 1.25 -0.00 -1.26 0.15 115.22 110.52 2qp0 n HIS 13 Ca 0.08 1.11 -0.13 0.00 -0.00 0.00 0.00 57.72 58.78 2qp0 n HIS 13 Cb 0.37 -1.20 -0.10 0.00 -0.00 0.00 0.00 29.99 29.06 2qp0 n HIS 13 CO 0.00 0.00 0.00 1.25 -0.00 0.00 0.00 176.34 177.59 2qp0 h LEU 14 N 0.00 0.03 -0.02 2.41 6.46 -1.14 -3.14 115.31 119.91 2qp0 h LEU 14 Ca 0.57 -0.51 0.00 0.00 -0.12 0.00 0.00 57.88 57.82 2qp0 h LEU 14 Cb 1.19 -0.01 0.00 0.00 -0.73 0.00 0.00 40.66 41.11 2qp0 h LEU 14 CO -0.86 0.54 0.00 -0.11 -0.62 0.00 0.00 178.44 177.39 2qp0 n LEU 15 N -4.82 0.05 -0.04 2.25 0.00 0.13 -2.40 117.00 112.17 2qp0 n LEU 15 Ca -0.08 0.51 -0.12 0.00 0.00 0.00 0.00 56.01 56.31 2qp0 n LEU 15 Cb 0.27 -0.50 -0.07 0.00 0.00 0.00 0.00 43.42 43.13 2qp0 n LEU 15 CO 0.34 -0.11 0.70 0.50 0.00 0.00 0.00 177.39 178.81 2qp0 h LYS 16 N 0.00 0.23 0.04 1.96 3.64 0.15 -2.90 116.57 119.69 2qp0 h LYS 16 Ca 0.00 -0.09 -0.28 0.00 -1.27 0.00 0.00 60.65 59.01 2qp0 h LYS 16 Cb 0.41 -0.01 -0.03 0.00 -0.41 0.00 0.00 32.23 32.19 2qp0 h LYS 16 CO 0.00 0.54 -1.52 1.63 -2.27 0.00 0.00 179.45 177.83 2qp0 n LYS 17 N -4.74 0.62 -0.09 1.90 4.76 -1.21 -4.04 118.16 115.37 2qp0 n LYS 17 Ca -0.06 0.48 0.18 0.00 -2.87 0.00 0.00 58.31 56.03 2qp0 n LYS 17 Cb 0.25 -1.73 0.59 0.00 -1.84 0.00 0.00 35.03 32.30 2qp0 n LYS 17 CO 0.00 0.00 0.00 -0.24 -1.37 0.00 0.00 177.40 175.79 2qp0 h VAL 18 N -0.69 0.77 -0.03 -0.18 3.04 -1.64 0.17 116.25 117.69 2qp0 h VAL 18 Ca -0.38 -0.08 -0.00 0.00 -1.01 0.00 0.00 66.70 65.23 2qp0 h VAL 18 Cb 1.53 0.52 -0.00 0.00 -2.01 0.00 0.00 31.29 31.33 2qp0 h VAL 18 CO -0.13 0.04 0.01 -0.08 -1.01 0.00 0.00 177.57 176.40 2qp0 h GLU 19 N 0.23 0.06 -0.52 4.17 4.57 -1.68 -0.76 114.58 120.65 2qp0 h GLU 19 Ca 0.32 -0.01 -0.09 0.00 -1.18 0.00 0.00 59.36 58.39 2qp0 h GLU 19 Cb 0.93 -0.01 -0.02 0.00 -0.16 0.00 0.00 28.75 29.49 2qp0 h GLU 19 CO -0.06 0.26 -0.04 -0.22 -1.18 0.00 0.00 179.01 177.77 2qp0 h LYS 20 N -0.16 0.90 -0.97 1.92 3.11 -1.40 -2.54 116.57 117.42 2qp0 h LYS 20 Ca 0.01 -0.28 0.09 0.00 -2.81 0.00 0.00 60.65 57.66 2qp0 h LYS 20 Cb 0.23 -0.09 -0.07 0.00 -1.00 0.00 0.00 32.23 31.30 2qp0 h LYS 20 CO -0.00 0.92 0.63 0.00 -2.81 0.00 0.00 179.45 178.19 2qp0 h ALA 21 N 1.12 1.50 -0.89 5.00 0.00 -0.45 0.69 119.26 126.22 2qp0 h ALA 21 Ca 0.15 -0.01 0.17 0.00 0.00 0.00 0.00 54.91 55.22 2qp0 h ALA 21 Cb 0.54 -0.26 -0.10 0.00 0.00 0.00 0.00 17.79 17.98 2qp0 h ALA 21 CO 0.03 0.32 0.47 0.28 0.00 0.00 0.00 179.25 180.35 2qp0 h VAL 22 N 1.05 0.67 0.08 0.00 2.07 -0.69 1.70 116.25 121.13 2qp0 h VAL 22 Ca 0.44 -0.21 -0.35 0.00 0.82 0.00 0.00 66.70 67.40 2qp0 h VAL 22 Cb 0.31 0.01 -0.03 0.00 -1.52 0.00 0.00 31.29 30.06 2qp0 h VAL 22 CO -0.20 0.11 -2.00 -1.84 0.02 0.00 0.00 177.57 173.67 2qp0 n GLU 23 N -4.88 0.70 -0.13 1.57 -0.00 -0.52 -4.36 120.64 113.02 2qp0 n GLU 23 Ca 0.20 0.29 -0.12 0.00 -0.00 0.00 0.00 57.16 57.53 2qp0 n GLU 23 Cb 0.51 -1.67 -0.02 0.00 -0.00 0.00 0.00 31.44 30.26 2qp0 n GLU 23 CO 0.00 0.00 0.00 0.66 0.00 0.00 0.00 177.13 177.79 2qp0 h SER 24 N -0.17 0.88 0.00 -1.84 4.64 0.55 -3.48 113.55 114.13 2qp0 h SER 24 Ca -0.46 -0.41 0.00 0.00 -0.47 0.00 0.00 61.79 60.46 2qp0 h SER 24 Cb 1.88 -0.24 0.00 0.00 -0.31 0.00 0.00 62.40 63.72 2qp0 h SER 24 CO -0.02 1.10 0.00 0.61 -0.87 0.00 0.00 176.83 177.65 2qp0 n GLY 25 N -0.05 4.63 3.48 -0.77 0.00 0.58 -5.02 105.19 108.04 2qp0 n GLY 25 Ca -0.01 -0.70 -0.33 0.00 0.00 0.00 0.00 46.02 44.97 2qp0 n GLY 25 CO 0.00 0.00 0.00 0.51 0.00 0.00 0.00 173.32 173.83 2qp0 s ASP 26 N 0.00 4.15 0.00 1.61 1.47 -1.19 -4.57 116.67 118.14 2qp0 s ASP 26 Ca 0.00 -0.18 0.00 0.00 1.18 0.00 0.00 52.55 53.55 2qp0 s ASP 26 Cb 0.00 -1.00 0.00 0.00 -0.34 0.00 0.00 42.92 41.58 2qp0 s ASP 26 CO 0.00 0.33 0.00 2.29 0.68 0.00 0.00 175.17 178.47 2qp0 n LYS 27 N 2.44 0.00 -1.67 2.11 0.00 -1.26 -5.08 118.16 114.70 2qp0 n LYS 27 Ca -0.17 0.00 -0.40 0.00 -0.00 0.00 0.00 58.31 57.74 2qp0 n LYS 27 Cb 0.52 0.00 0.03 0.00 -0.00 0.00 0.00 35.03 35.58 2qp0 n LYS 27 CO 0.00 0.00 0.00 0.36 0.00 0.00 0.00 177.40 177.76 2qp0 n LYS 28 N -1.16 1.51 -0.46 -1.58 0.00 -1.26 -4.75 118.16 110.46 2qp0 n LYS 28 Ca 0.00 0.55 -0.31 0.00 -0.00 0.00 0.00 58.31 58.55 2qp0 n LYS 28 Cb 0.00 -2.32 0.29 0.00 -0.00 0.00 0.00 35.03 33.00 2qp0 n LYS 28 CO 0.00 0.00 0.00 -1.25 0.00 0.00 0.00 177.40 176.15 2qp0 s PRO 29 N -2.49 -2.90 -0.41 -1.58 0.04 -1.26 -4.73 135.00 121.66 2qp0 s PRO 29 Ca 0.68 0.04 0.02 0.00 0.04 0.00 0.00 61.00 61.78 2qp0 s PRO 29 Cb -0.47 -1.39 0.11 0.00 0.04 0.00 0.00 34.50 32.79 2qp0 s PRO 29 CO 0.53 -4.83 0.16 -0.51 0.04 0.00 0.00 177.00 172.38 2qp0 s LEU 30 N -7.78 4.84 -1.01 -3.56 1.43 0.48 -4.87 118.68 108.21 2qp0 s LEU 30 Ca 0.69 -2.35 -0.23 0.00 -1.03 0.00 0.00 54.13 51.21 2qp0 s LEU 30 Cb -0.11 -1.70 0.05 0.00 0.03 0.00 0.00 46.19 44.45 2qp0 s LEU 30 CO 0.57 -0.39 1.46 -0.13 0.23 0.00 0.00 176.35 178.09 2qp0 s ARG 31 N 0.65 3.55 0.24 1.70 3.00 -1.26 0.18 118.95 127.02 2qp0 s ARG 31 Ca 0.12 -1.07 0.04 0.00 0.00 0.00 0.00 55.73 54.82 2qp0 s ARG 31 Cb -0.21 -5.32 -0.02 0.00 0.00 0.00 0.00 34.95 29.40 2qp0 s ARG 31 CO -0.05 -2.25 0.16 2.41 0.00 0.00 0.00 175.30 175.57 2qp0 n THR 32 N 6.91 0.00 -1.14 0.02 -1.04 -1.13 -5.03 114.28 112.88 2qp0 n THR 32 Ca 0.33 -1.64 0.02 0.00 -2.04 0.00 0.00 64.05 60.72 2qp0 n THR 32 Cb 0.51 0.74 0.03 0.00 -1.82 0.00 0.00 70.33 69.79 2qp0 n THR 32 CO 0.00 0.00 0.00 0.79 -0.64 0.00 0.00 175.07 175.22 2qp0 n TRP 33 N -0.50 0.00 0.49 -1.42 8.01 -1.26 -2.81 117.44 119.95 2qp0 n TRP 33 Ca 0.02 -0.31 0.00 0.00 -1.31 0.00 0.00 57.50 55.90 2qp0 n TRP 33 Cb 0.41 -0.06 0.00 0.00 -2.01 0.00 0.00 31.31 29.65 2qp0 n TRP 33 CO 0.00 0.00 0.00 -1.13 -1.01 0.00 0.00 177.69 175.55 2qp0 n SER 34 N -0.41 0.34 0.17 -0.99 3.41 -1.26 -3.79 113.62 111.09 2qp0 n SER 34 Ca 0.03 -0.83 0.09 0.00 -0.26 0.00 0.00 58.87 57.91 2qp0 n SER 34 Cb 0.55 -0.17 0.46 0.00 -0.26 0.00 0.00 64.21 64.79 2qp0 n SER 34 CO 0.00 0.00 0.00 0.08 -0.16 0.00 0.00 175.04 174.96 2qp0 h ARG 35 N 0.48 0.00 0.00 4.33 0.11 -1.87 0.28 114.38 117.71 2qp0 h ARG 35 Ca 0.00 0.00 -0.12 0.00 0.10 0.00 0.00 59.98 59.96 2qp0 h ARG 35 Cb 0.17 0.00 -0.02 0.00 1.11 0.00 0.00 29.97 31.23 2qp0 h ARG 35 CO 0.00 0.00 -0.58 0.00 0.10 0.00 0.00 179.97 179.49 2qp0 h ARG 36 N 0.00 0.00 -6.96 0.08 3.08 -1.86 -0.11 114.38 108.61 2qp0 h ARG 36 Ca 0.00 0.00 -0.45 0.00 0.07 0.00 0.00 59.98 59.60 2qp0 h ARG 36 Cb 0.40 0.00 0.05 0.00 0.08 0.00 0.00 29.97 30.50 2qp0 h ARG 36 CO 0.00 0.58 0.05 -1.54 -1.07 0.00 0.00 179.97 177.99 2qp0 s SER 37 N -6.54 5.38 0.48 7.04 1.04 0.99 -4.82 113.70 117.27 2qp0 s SER 37 Ca 0.02 0.31 -0.02 0.00 0.48 0.00 0.00 55.95 56.74 2qp0 s SER 37 Cb 0.10 -1.26 -0.01 0.00 0.10 0.00 0.00 66.02 64.94 2qp0 s SER 37 CO 0.74 -1.11 0.73 -0.89 0.98 0.00 0.00 173.24 173.69 2qp0 s THR 38 N -2.86 4.21 0.35 2.02 2.01 -1.22 -0.38 115.64 119.77 2qp0 s THR 38 Ca 0.55 -0.25 0.05 0.00 0.31 0.00 0.00 61.69 62.35 2qp0 s THR 38 Cb -0.10 -3.59 -0.01 0.00 0.01 0.00 0.00 72.50 68.81 2qp0 s THR 38 CO 0.41 -0.48 0.50 -0.63 -0.69 0.00 0.00 174.62 173.73 2qp0 s ILE 39 N -2.66 4.12 0.05 1.82 1.01 0.00 -4.76 121.20 120.79 2qp0 s ILE 39 Ca 0.48 -0.91 -0.04 0.00 0.00 0.00 0.00 60.65 60.18 2qp0 s ILE 39 Cb -0.10 -3.45 -0.02 0.00 0.01 0.00 0.00 42.46 38.90 2qp0 s ILE 39 CO 0.41 -0.20 0.05 -0.36 0.00 0.00 0.00 174.94 174.84 2qp0 s PHE 40 N -2.23 0.34 0.25 3.97 0.40 -1.26 -4.39 117.98 115.06 2qp0 s PHE 40 Ca 0.45 -0.79 0.36 0.00 -0.60 0.00 0.00 56.93 56.35 2qp0 s PHE 40 Cb -0.10 -0.24 1.76 0.00 0.51 0.00 0.00 43.02 44.95 2qp0 s PHE 40 CO 0.32 -0.41 2.09 -1.00 0.70 0.00 0.00 175.22 176.92 2qp0 h PRO 41 N 3.25 0.00 0.00 0.24 0.13 -1.93 -2.08 132.00 131.61 2qp0 h PRO 41 Ca -0.34 0.00 0.00 0.00 -0.87 0.00 0.00 66.00 64.79 2qp0 h PRO 41 Cb 1.17 0.00 0.00 0.00 0.13 0.00 0.00 31.00 32.30 2qp0 h PRO 41 CO 0.59 0.00 0.00 0.27 -0.23 0.00 0.00 178.00 178.63 2qp0 n ASN 42 N -2.91 0.13 -1.07 1.44 2.04 -1.26 -1.76 115.26 111.87 2qp0 n ASN 42 Ca -0.01 0.54 0.04 0.00 -0.44 0.00 0.00 54.58 54.71 2qp0 n ASN 42 Cb 0.17 -0.56 0.05 0.00 -2.53 0.00 0.00 39.78 36.91 2qp0 n ASN 42 CO 0.00 0.00 0.00 0.23 -0.44 0.00 0.00 177.26 177.05 2qp0 n MET 43 N -1.65 0.33 -1.92 -3.83 2.81 -0.79 -4.99 117.12 107.07 2qp0 n MET 43 Ca 0.02 -2.04 -0.38 0.00 -1.81 0.00 0.00 57.70 53.49 2qp0 n MET 43 Cb 0.11 -0.45 0.03 0.00 -0.71 0.00 0.00 33.22 32.20 2qp0 n MET 43 CO 0.00 0.00 0.00 -1.50 1.51 0.00 0.00 175.97 175.98 2qp0 s ILE 44 N -0.68 2.38 0.00 2.02 2.07 -0.72 -2.48 121.20 123.78 2qp0 s ILE 44 Ca 0.28 0.28 0.00 0.00 -1.41 0.00 0.00 60.65 59.80 2qp0 s ILE 44 Cb 0.30 -3.14 0.00 0.00 0.13 0.00 0.00 42.46 39.75 2qp0 s ILE 44 CO -0.11 -0.01 0.00 0.61 -1.91 0.00 0.00 174.94 173.53 2qp0 n GLY 45 N 0.64 0.00 3.58 1.50 0.00 0.21 -4.85 105.19 106.28 2qp0 n GLY 45 Ca 0.10 0.00 -0.28 0.00 0.00 0.00 0.00 46.02 45.83 2qp0 n GLY 45 CO 0.00 0.00 0.00 1.08 0.00 0.00 0.00 173.32 174.40 2qp0 s LEU 46 N 0.00 1.17 -0.57 0.99 2.01 -1.03 -4.63 118.68 116.61 2qp0 s LEU 46 Ca 0.00 1.32 -0.19 0.00 0.01 0.00 0.00 54.13 55.27 2qp0 s LEU 46 Cb 0.00 -3.36 0.09 0.00 0.01 0.00 0.00 46.19 42.93 2qp0 s LEU 46 CO 0.00 -3.69 0.71 -0.89 1.01 0.00 0.00 176.35 173.49 2qp0 s THR 47 N -2.73 4.78 0.18 5.49 2.01 -1.26 -3.90 115.64 120.21 2qp0 s THR 47 Ca 0.67 -0.78 0.08 0.00 0.31 0.00 0.00 61.69 61.97 2qp0 s THR 47 Cb -0.22 -4.46 -0.04 0.00 0.01 0.00 0.00 72.50 67.80 2qp0 s THR 47 CO 0.61 -1.07 -0.07 -0.63 -0.69 0.00 0.00 174.62 172.77 2qp0 s ILE 48 N 2.82 3.33 -0.40 1.82 1.09 -1.17 -0.39 121.20 128.30 2qp0 s ILE 48 Ca 0.14 -1.60 0.03 0.00 -1.10 0.00 0.00 60.65 58.12 2qp0 s ILE 48 Cb -0.22 -2.66 0.16 0.00 -1.06 0.00 0.00 42.46 38.69 2qp0 s ILE 48 CO 0.08 -0.11 0.34 0.00 -0.10 0.00 0.00 174.94 175.15 2qp0 s ALA 49 N -1.71 0.95 0.15 9.38 0.00 0.13 -0.80 121.76 129.86 2qp0 s ALA 49 Ca 0.26 -2.11 -0.30 0.00 0.00 0.00 0.00 51.96 49.81 2qp0 s ALA 49 Cb -0.09 -1.69 -0.07 0.00 0.00 0.00 0.00 23.12 21.27 2qp0 s ALA 49 CO 0.16 -2.03 1.07 0.08 0.00 0.00 0.00 175.76 175.04 2qp0 s VAL 50 N 0.41 4.05 0.14 0.00 1.01 -0.78 -2.82 120.40 122.40 2qp0 s VAL 50 Ca 0.29 1.72 -0.14 0.00 0.00 0.00 0.00 61.98 63.85 2qp0 s VAL 50 Cb -0.03 -4.10 -0.07 0.00 0.00 0.00 0.00 36.38 32.18 2qp0 s VAL 50 CO -0.14 0.27 0.54 -2.28 0.00 0.00 0.00 175.10 173.50 2qp0 s HIS 51 N -0.06 3.62 0.00 5.22 2.46 -1.12 0.24 115.29 125.65 2qp0 s HIS 51 Ca 0.50 1.06 0.00 0.00 0.47 0.00 0.00 55.06 57.08 2qp0 s HIS 51 Cb -0.28 -2.36 0.00 0.00 -0.13 0.00 0.00 32.58 29.81 2qp0 s HIS 51 CO 0.33 0.44 0.03 0.27 -2.47 0.00 0.00 174.74 173.34 2qp0 n ASN 52 N 0.87 0.05 0.00 9.88 6.94 -1.03 -4.92 115.26 127.05 2qp0 n ASN 52 Ca -0.06 -0.53 0.00 0.00 -0.02 0.00 0.00 54.58 53.98 2qp0 n ASN 52 Cb 0.52 0.95 0.00 0.00 -2.36 0.00 0.00 39.78 38.88 2qp0 n ASN 52 CO 0.00 0.00 0.00 0.61 -1.03 0.00 0.00 177.26 176.84 2qp0 n GLY 53 N 0.95 1.31 0.31 4.83 0.00 -1.26 -4.67 105.19 106.66 2qp0 n GLY 53 Ca 0.00 0.00 -0.03 0.00 0.00 0.00 0.00 46.02 45.99 2qp0 n GLY 53 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 173.32 173.86 2qp0 n ARG 54 N 0.00 0.20 -4.26 1.61 1.74 -1.26 -5.11 116.66 109.58 2qp0 n ARG 54 Ca 0.00 0.08 -0.19 0.00 -0.77 0.00 0.00 57.85 56.97 2qp0 n ARG 54 Cb 0.00 -0.79 -0.08 0.00 -1.02 0.00 0.00 32.46 30.58 2qp0 n ARG 54 CO 0.00 0.00 0.00 -1.14 -1.52 0.00 0.00 177.63 174.97 2qp0 s GLN 55 N -1.86 1.79 -0.46 5.56 -0.44 -1.26 -5.12 119.66 117.87 2qp0 s GLN 55 Ca -0.11 -2.00 -0.19 0.00 -2.50 0.00 0.00 55.36 50.55 2qp0 s GLN 55 Cb 0.02 0.34 0.03 0.00 -1.64 0.00 0.00 33.01 31.76 2qp0 s GLN 55 CO 0.16 -0.67 0.59 -1.01 0.50 0.00 0.00 175.29 174.86 2qp0 s HIS 56 N -3.37 3.08 -0.30 1.67 3.76 -1.26 -2.46 115.29 116.42 2qp0 s HIS 56 Ca 0.40 -0.29 -0.29 0.00 -0.15 0.00 0.00 55.06 54.73 2qp0 s HIS 56 Cb 0.02 -3.30 -0.01 0.00 1.11 0.00 0.00 32.58 30.40 2qp0 s HIS 56 CO 0.27 -0.89 1.43 0.14 -0.85 0.00 0.00 174.74 174.85 2qp0 s VAL 57 N 2.60 3.95 -0.05 -0.90 -7.23 0.67 -4.58 120.40 114.86 2qp0 s VAL 57 Ca 0.18 1.05 -0.30 0.00 -1.81 0.00 0.00 61.98 61.10 2qp0 s VAL 57 Cb -0.16 -4.02 -0.05 0.00 0.56 0.00 0.00 36.38 32.71 2qp0 s VAL 57 CO 0.15 -0.47 1.54 -2.16 -0.31 0.00 0.00 175.10 173.85 2qp0 s PRO 58 N 4.49 4.21 -0.12 4.82 0.04 -1.26 -1.88 135.00 145.32 2qp0 s PRO 58 Ca 0.62 2.06 -0.06 0.00 0.04 0.00 0.00 61.00 63.66 2qp0 s PRO 58 Cb -0.19 -3.84 0.05 0.00 0.04 0.00 0.00 34.50 30.56 2qp0 s PRO 58 CO 0.27 -0.76 0.27 0.14 0.04 0.00 0.00 177.00 176.96 2qp0 s VAL 59 N 3.51 -0.04 -0.11 -0.36 -7.23 0.02 -4.97 120.40 111.23 2qp0 s VAL 59 Ca 0.68 0.13 -0.10 0.00 -1.81 0.00 0.00 61.98 60.88 2qp0 s VAL 59 Cb -0.31 -0.42 -0.05 0.00 0.56 0.00 0.00 36.38 36.16 2qp0 s VAL 59 CO 0.26 0.05 0.22 -0.36 -0.31 0.00 0.00 175.10 174.96 2qp0 s PHE 60 N 1.22 3.59 0.53 2.82 2.99 -1.26 -3.03 117.98 124.84 2qp0 s PHE 60 Ca -0.09 0.62 -0.21 0.00 0.00 0.00 0.00 56.93 57.25 2qp0 s PHE 60 Cb -0.10 -2.09 -0.06 0.00 0.00 0.00 0.00 43.02 40.78 2qp0 s PHE 60 CO -0.09 0.61 1.19 0.08 -0.00 0.00 0.00 175.22 177.01 2qp0 s VAL 61 N -0.72 2.88 0.47 -0.44 1.01 -1.25 -4.75 120.40 117.59 2qp0 s VAL 61 Ca 0.16 0.60 0.06 0.00 0.00 0.00 0.00 61.98 62.80 2qp0 s VAL 61 Cb -0.13 -3.27 0.06 0.00 0.00 0.00 0.00 36.38 33.04 2qp0 s VAL 61 CO 0.05 -0.07 0.51 0.41 0.00 0.00 0.00 175.10 176.00 2qp0 n THR 62 N -1.06 0.00 0.28 3.92 -1.04 -1.26 0.67 114.28 115.79 2qp0 n THR 62 Ca 0.11 -1.71 0.09 0.00 -2.04 0.00 0.00 64.05 60.49 2qp0 n THR 62 Cb 0.49 -0.36 0.41 0.00 -1.82 0.00 0.00 70.33 69.05 2qp0 n THR 62 CO 0.00 0.00 0.00 -0.67 -0.64 0.00 0.00 175.07 173.76 2qp0 n ASP 63 N -2.16 0.41 0.00 8.00 4.64 -1.26 -2.91 116.55 123.27 2qp0 n ASP 63 Ca 0.06 0.64 0.00 0.00 -1.38 0.00 0.00 54.79 54.11 2qp0 n ASP 63 Cb 0.51 -0.71 0.00 0.00 -1.04 0.00 0.00 41.12 39.88 2qp0 n ASP 63 CO 0.00 0.00 0.00 -0.62 -0.82 0.00 0.00 177.20 175.76 2qp0 n GLU 64 N -1.99 2.36 0.00 -0.67 4.71 -1.26 -4.73 120.64 119.06 2qp0 n GLU 64 Ca 0.01 0.00 0.00 0.00 -0.01 0.00 0.00 57.16 57.16 2qp0 n GLU 64 Cb 0.12 -0.77 0.00 0.00 -1.01 0.00 0.00 31.44 29.78 2qp0 n GLU 64 CO 0.00 0.00 0.00 -0.12 0.09 0.00 0.00 177.13 177.10 2qp0 n MET 65 N -0.94 0.25 -0.06 3.49 1.56 -1.15 -2.76 117.12 117.51 2qp0 n MET 65 Ca 0.00 0.00 -0.19 0.00 -0.27 0.00 0.00 57.70 57.24 2qp0 n MET 65 Cb 0.00 -1.16 -0.13 0.00 2.15 0.00 0.00 33.22 34.07 2qp0 n MET 65 CO 0.00 0.00 0.00 1.33 -0.73 0.00 0.00 175.97 176.57 2qp0 n VAL 66 N 0.45 1.64 0.58 1.12 0.24 -1.26 -4.29 118.33 116.80 2qp0 n VAL 66 Ca 0.00 -0.64 0.00 0.00 -2.04 0.00 0.00 64.34 61.66 2qp0 n VAL 66 Cb 0.07 -1.50 0.00 0.00 -1.47 0.00 0.00 33.84 30.94 2qp0 n VAL 66 CO 0.00 0.00 0.00 0.61 -2.14 0.00 0.00 176.83 175.30 2qp0 n GLY 67 N 2.06 1.00 3.20 7.63 0.00 -1.11 -3.05 105.19 114.92 2qp0 n GLY 67 Ca -0.37 0.00 -0.12 0.00 0.00 0.00 0.00 46.02 45.54 2qp0 n GLY 67 CO 0.00 0.00 0.00 0.30 0.00 0.00 0.00 173.32 173.62 2qp0 s HIS 68 N -0.32 1.03 0.63 1.61 3.76 -1.26 -4.99 115.29 115.75 2qp0 s HIS 68 Ca 0.00 -0.98 -0.14 0.00 -0.15 0.00 0.00 55.06 53.79 2qp0 s HIS 68 Cb 0.00 -0.59 -0.02 0.00 1.11 0.00 0.00 32.58 33.08 2qp0 s HIS 68 CO 0.00 -0.20 1.06 0.15 -0.85 0.00 0.00 174.74 174.90 2qp0 s LYS 69 N -3.88 3.15 0.00 1.40 -0.14 -1.26 -0.82 119.74 118.19 2qp0 s LYS 69 Ca 0.18 1.11 0.00 0.00 -1.36 0.00 0.00 55.97 55.90 2qp0 s LYS 69 Cb 0.06 -2.01 0.00 0.00 -1.68 0.00 0.00 37.83 34.19 2qp0 s LYS 69 CO -0.01 -0.93 0.51 -0.11 -0.76 0.00 0.00 175.35 174.05 2qp0 n LEU 70 N -2.47 1.09 -0.03 3.17 7.94 0.48 -4.07 117.00 123.11 2qp0 n LEU 70 Ca 0.08 -0.54 -0.05 0.00 -1.11 0.00 0.00 56.01 54.39 2qp0 n LEU 70 Cb 0.53 -0.48 -0.02 0.00 0.53 0.00 0.00 43.42 43.99 2qp0 n LEU 70 CO 0.50 0.26 -0.36 0.61 -1.11 0.00 0.00 177.39 177.29 2qp0 n GLY 71 N 0.06 -0.34 0.29 -3.96 0.00 -0.08 -4.26 105.19 96.91 2qp0 n GLY 71 Ca 0.00 -0.18 0.22 0.00 0.00 0.00 0.00 46.02 46.07 2qp0 n GLY 71 CO 0.00 0.00 0.00 -1.84 0.00 0.00 0.00 173.32 171.48 2qp0 n GLU 72 N -3.87 -0.06 -0.28 1.61 0.28 -1.26 0.10 120.64 117.17 2qp0 n GLU 72 Ca -0.07 1.24 0.00 0.00 -0.16 0.00 0.00 57.16 58.16 2qp0 n GLU 72 Cb 0.28 -2.13 0.00 0.00 1.43 0.00 0.00 31.44 31.02 2qp0 n GLU 72 CO 0.00 0.00 0.00 1.19 -0.16 0.00 0.00 177.13 178.16 2qp0 n PHE 73 N -5.07 0.00 -2.74 -1.84 3.01 -1.26 -3.80 117.46 105.76 2qp0 n PHE 73 Ca 0.29 -0.62 -0.07 0.00 1.01 0.00 0.00 57.45 58.05 2qp0 n PHE 73 Cb 0.96 -0.38 0.05 0.00 -0.01 0.00 0.00 39.48 40.10 2qp0 n PHE 73 CO 0.00 0.00 0.00 0.00 1.01 0.00 0.00 176.76 177.77 2qp0 n ALA 74 N 1.47 -1.87 -1.66 4.37 0.00 0.28 -4.95 120.51 118.15 2qp0 n ALA 74 Ca 0.00 -1.15 -0.42 0.00 0.00 0.00 0.00 53.44 51.86 2qp0 n ALA 74 Cb 0.34 -1.71 -0.03 0.00 0.00 0.00 0.00 19.45 18.05 2qp0 n ALA 74 CO 0.00 0.00 0.00 -0.35 0.00 0.00 0.00 177.50 177.15 2qp0 n PRO 75 N 1.76 2.83 0.00 0.00 -0.04 -1.25 -4.83 135.00 133.47 2qp0 n PRO 75 Ca 0.09 1.04 0.00 0.00 -0.04 0.00 0.00 63.50 64.58 2qp0 n PRO 75 Cb 0.64 -2.98 0.00 0.00 -0.04 0.00 0.00 33.50 31.11 2qp0 n PRO 75 CO 0.00 0.00 0.00 0.25 -0.04 0.00 0.00 175.50 175.71 2qp0 n THR 76 N 5.45 0.00 -1.32 0.52 -2.24 -1.26 -4.90 114.28 110.54 2qp0 n THR 76 Ca 0.20 0.74 -0.36 0.00 -2.27 0.00 0.00 64.05 62.36 2qp0 n THR 76 Cb 0.40 -1.60 0.07 0.00 -2.10 0.00 0.00 70.33 67.09 2qp0 n THR 76 CO 0.00 0.00 0.00 -2.11 -0.57 0.00 0.00 175.07 172.39 2qp0 n ARG 77 N -1.69 0.39 -4.91 -0.78 1.85 -1.26 -4.94 116.66 105.31 2qp0 n ARG 77 Ca 0.00 0.18 -0.33 0.00 -1.00 0.00 0.00 57.85 56.70 2qp0 n ARG 77 Cb 0.00 -1.92 -0.15 0.00 -1.05 0.00 0.00 32.46 29.34 2qp0 n ARG 77 CO 0.00 0.00 0.00 0.99 -0.01 0.00 0.00 177.63 178.61 2qp0 s THR 78 N -1.86 2.79 -0.05 8.89 2.01 -1.26 -5.12 115.64 121.04 2qp0 s THR 78 Ca 0.68 -0.77 0.04 0.00 0.31 0.00 0.00 61.69 61.96 2qp0 s THR 78 Cb -0.36 -2.14 -0.00 0.00 0.01 0.00 0.00 72.50 70.01 2qp0 s THR 78 CO 0.55 0.54 -0.19 -0.47 -0.69 0.00 0.00 174.62 174.37 2qp0 s TYR 79 N 0.20 1.91 0.00 4.92 5.04 -1.26 -5.31 117.35 122.85 2qp0 s TYR 79 Ca -0.10 -0.59 0.00 0.00 -2.44 0.00 0.00 57.07 53.94 2qp0 s TYR 79 Cb -0.16 -1.28 0.00 0.00 0.35 0.00 0.00 41.96 40.87 2qp0 s TYR 79 CO 0.06 -0.21 0.00 0.54 -1.34 0.00 0.00 175.55 174.60